N-(3-azanylpropyl)-4-bromanyl-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-bromanyl-N-[1-[7-chloranyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxo-quinazolin-2-yl)propyl]-4-bromo-benzamide CAS Name: N-(3-aminopropyl)-4-bromo-N-[1-[7-chloro-4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]benzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)propyl]-4-bromobenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-7-chloro-4-keto-quinazolin-2-yl)propyl]-4-bromo-benzamide Formula: C28H28BrClN4O2 MolecularWeight: 567.90452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CC=C3)N(CCCN)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H28BrClN4O2/c1-2-25(33(16-6-15-31)27(35)20-9-11-21(29)12-10-20)26-32-24-17-22(30)13-14-23(24)28(36)34(26)18-19-7-4-3-5-8-19/h3-5,7-14,17,25H,2,6,15-16,18,31H2,1H3